ChemSpider 2D Image | 1-Deoxy-1-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)amino]-5-O-phosphono-D-ribitol | C9H16N3O9P

1-Deoxy-1-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)amino]-5-O-phosphono-D-ribitol

  • Molecular FormulaC9H16N3O9P
  • Average mass341.212 Da
  • Monoisotopic mass341.062408 Da
  • ChemSpider ID24828782

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-Deoxy-1-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)amino]-5-O-phosphono-D-ribitol [ACD/IUPAC Name]
1-Desoxy-1-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)amino]-5-O-phosphono-D-ribitol [German] [ACD/IUPAC Name]
1-Désoxy-1-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)amino]-5-O-phosphono-D-ribitol [French] [ACD/IUPAC Name]
D-Ribitol, 1-deoxy-1-[(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)amino]-, 5-(dihydrogen phosphate) [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.650
Molar Refractivity: 69.1±0.4 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -3.75
ACD/LogD (pH 5.5): -7.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 199 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 109.2±5.0 dyne/cm
Molar Volume: 189.4±5.0 cm3

Click to predict properties on the Chemicalize site


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